| SpectraBase Spectrum ID |
E9uYCfIrZqv |
| Name |
Carbonic acid, monoamide, N-benzyl-N-propyl-, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
207.125928789 u |
| Formula |
C12H17NO2 |
| InChI |
InChI=1S/C12H17NO2/c1-3-9-13(12(14)15-2)10-11-7-5-4-6-8-11/h4-8H,3,9-10H2,1-2H3 |
| InChIKey |
RQELFLVBBZBQKF-UHFFFAOYSA-N |
| Molecular Weight |
207.273 g/mol |
| SMILES |
COC(=O)N(CCC)CC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.825149 |
